ethyl 3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]quinoxaline-2-carboxylate

Systemtic Name: ethyl 3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]quinoxaline-2-carboxylate Openeye Name: ethyl 3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]quinoxaline-2-carboxylate CAS Name: 3-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-2-quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]quinoxaline-2-carboxylate Traditional Name: 3-[4-(3-fluorophenyl)sulfonylpiperazino]quinoxaline-2-carboxylic acid ethyl ester Formula: C21H21FN4O4S MolecularWeight: 444.479243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)F

Isomeric SMILES

CCOC(=O)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)F

InChI

InChI=1S/C21H21FN4O4S/c1-2-30-21(27)19-20(24-18-9-4-3-8-17(18)23-19)25-10-12-26(13-11-25)31(28,29)16-7-5-6-15(22)14-16/h3-9,14H,2,10-13H2,1H3